(8Xi,9Xi,14Xi,16α,17Beta)-3-(Cyclopentyloxy)Estra-1,3,5(10)-Triene-16,17-Diol

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Formula C23H32O3
IUPAC Name (8s,9s,13s,14r,16r,17r)-3-(cyclopentoxy)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-16,17-diol
Molecular Mass 356.498 g·mol−1
Heat of Formation -652.3 ± 16.7 kJ·mol−1
Dipole Moment 2.95 ± 1.08 D
Volume 442.95 Å 3
Surface Area 372.92 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy 0.39 ± eV
Point Group Symmetry C1
InChIKey ODYKCPYPRCJXLY-AJIIZAQNSA-N
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